# generated using pymatgen
data_Li2V3CuO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97858048
_cell_length_b   5.97858048
_cell_length_c   5.97858056
_cell_angle_alpha   59.27737793
_cell_angle_beta   59.27737793
_cell_angle_gamma   59.27738434
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2V3CuO8
_chemical_formula_sum   'Li2 V3 Cu1 O8'
_cell_volume   148.61850573
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.87581100  0.87581100  0.87581100  1
  Li  Li1  1  0.12418900  0.12418900  0.12418900  1
  V  V2  1  0.50000000  0.50000000  0.00000000  1
  V  V3  1  0.00000000  0.50000000  0.50000000  1
  V  V4  1  0.50000000  0.00000000  0.50000000  1
  Cu  Cu5  1  0.50000000  0.50000000  0.50000000  1
  O  O6  1  0.73941100  0.73941100  0.73941100  1
  O  O7  1  0.74884500  0.28743800  0.74884500  1
  O  O8  1  0.28743800  0.74884500  0.74884500  1
  O  O9  1  0.74884500  0.74884500  0.28743800  1
  O  O10  1  0.25115500  0.25115500  0.71256200  1
  O  O11  1  0.71256200  0.25115500  0.25115500  1
  O  O12  1  0.25115500  0.71256200  0.25115500  1
  O  O13  1  0.26058900  0.26058900  0.26058900  1
